Information card for entry 4333211

Structure parameters

• Formula: C16 H30 Cl F5 N5 Si2 Ta
• Calculated formula: C16 H30 Cl F5 N5 Si2 Ta
• SMILES: C[N]1(C)N([Si](C)(C)C)[Ta]21(N([N]2(C)C)[Si](C)(C)C)(=Nc1c(c(c(c(c1F)F)F)F)F)Cl
• Title of publication: Volatile Imido−Hydrazido Compounds of the Refractory Metals Niobium, Tantalum, Molybdenum, and Tungsten
• Authors of publication: Gaess, Daniel; Harms, Klaus; Pokoj, Michael; Stolz, Wolfgang; Sundermeyer, Jörg
• Journal of publication: Inorganic Chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 16
• Pages of publication: 6688 - 6701
• a: 15.8391 ± 0.0012 Å
• b: 7.9386 ± 0.0004 Å
• c: 20.9423 ± 0.0016 Å
• α: 90°
• β: 93.747 ± 0.006°
• γ: 90°
• Cell volume: 2627.7 ± 0.3 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0327
• Residual factor for significantly intense reflections: 0.0229
• Weighted residual factors for significantly intense reflections: 0.0496
• Weighted residual factors for all reflections included in the refinement: 0.0515
• Goodness-of-fit parameter for all reflections included in the refinement: 0.921
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No